(4-azanyl-3-nitro-phenyl) methanesulfonate

Systemtic Name: (4-azanyl-3-nitro-phenyl) methanesulfonate Openeye Name: (4-amino-3-nitro-phenyl) methanesulfonate CAS Name: methanesulfonic acid (4-amino-3-nitrophenyl) ester IUPAC Name: (4-amino-3-nitrophenyl) methanesulfonate Traditional Name: methanesulfonic acid (4-amino-3-nitro-phenyl) ester Formula: C7H8N2O5S MolecularWeight: 232.21382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC(=C(C=C1)N)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OC1=CC(=C(C=C1)N)[N+](=O)[O-]

InChI

InChI=1S/C7H8N2O5S/c1-15(12,13)14-5-2-3-6(8)7(4-5)9(10)11/h2-4H,8H2,1H3